Monomers
Cyclohexyl methacrylate
Identifiers
IUPAC name
cyclohexyl 2-methylprop-2-enoate
InchI
InChI=1S/C10H16O2/c1-8(2)10(11)12-9-6-4-3-5-7-9/h9H,1,3-7H2,2H3
InchI Key
OIWOHHBRDFKZNC-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)OC1CCCCC1
Canonical SMILES
CC(=C)C(=O)OC1CCCCC1
Isomeric SMILES
CC(=C)C(=O)OC1CCCCC1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H16O2
Heavy Atom Count
12
Molecular Weight
168.236
Exact Molecular Weight
168.115
Valence Electrons
68
Radical Electrons
0
tPSA
26.3
MolLogP
2.4384
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0
MOL File
RDKit 3D
28 28 0 0 0 0 0 0 0 0999 V2000
1.4074 -0.3012 1.7398 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7599 -0.0276 0.5614 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1705 0.1062 0.2116 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5074 0.3923 -1.0258 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2489 -0.0717 1.2162 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7771 0.1406 -0.3822 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5968 0.0381 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1563 -1.1247 -0.9606 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6147 -1.3327 -0.6633 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1661 -0.2136 0.2203 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8209 1.0840 -0.4746 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3356 1.3268 -0.4377 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7155 0.5250 -1.7731 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5476 0.4939 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0257 0.7017 1.1647 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7439 -1.0519 0.9669 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8595 -0.1075 2.2507 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7553 -0.2047 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6200 -2.0331 -0.5954 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9477 -1.0485 -2.0374 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8583 -2.3131 -0.2532 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1702 -1.2264 -1.6383 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2888 -0.2972 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7690 -0.2457 1.2362 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2238 1.0132 -1.5125 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3560 1.9207 0.0259 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1349 2.0313 0.4034 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9491 1.8260 -1.3503 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 3
3 5 1 0
2 6 1 0
6 7 1 0
7 8 1 0
8 9 1 0
9 10 1 0
10 11 1 0
11 12 1 0
12 7 1 0
4 13 1 0
4 14 1 0
5 15 1 0
5 16 1 0
5 17 1 0
7 18 1 0
8 19 1 0
8 20 1 0
9 21 1 0
9 22 1 0
10 23 1 0
10 24 1 0
11 25 1 0
11 26 1 0
12 27 1 0
12 28 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers